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CIF Information Card
Information card for 2013199
2013198 << 2013199 >> 2013200Preview
|
Coordinates |
2013199.cif |
|
Structure factors |
2013199.hkl |
Structure parameters
| Formula | - C6 H8 N4 O4 - |
| Calculated formula | - C6 H8 N4 O4 - |
| Title of publication | Hydrogen bonding in nitroaniline analogues: hydrogen-bonded sheets in 2-amino-4,6-dimethoxy-5-nitropyrimidine and π-stacked hydrogen-bonded sheets in 4-amino-2,6-dimethoxy-5-nitropyrimidine |
| Authors of publication | Glidewell, Christopher; Low, John N.; Melguizo, Manuel; Quesada, Antonio |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2003 |
| Journal volume | 59 |
| Pages of publication | o14 - o18 |
| a | 7.3443 ± 0.0002 Å |
| b | 7.8437 ± 0.0002 Å |
| c | 14.9129 ± 0.0004 Å |
| α | 90° |
| β | 109.947 ± 0.0013° |
| γ | 90° |
| Cell volume | 807.54 ± 0.04 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |